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CS-W001157 4
Total: USD 88.00

Benzonitrile, 3-nitro-4-(trifluoromethyl)-

  • CAS No. 1227489-72-6

  • Cat. No. CS-0028807
  • Purity≥97%
  • MDL No.MFCD16606333

*For research and further manufacturing use only, not for direct human use.

Benzonitrile, 3-nitro-4-(trifluoromethyl)-|CS-0028807

Structure of 1227489-72-6

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General Information

  • CAS No. 1227489-72-6
  • Cat. No. CS-0028807
  • Purity ≥97%
  • MDL No. MFCD16606333
  • Storage Store at room temperature
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₈H₃F₃N₂O₂
  • Molecular Weight 216.12
  • Synonym(s) 3-Nitro-4-trifluoromethylbenzonitrile
  • SMILES N#CC1=CC=C(C(F)(F)F)C([N+]([O-])=O)=C1

Safety Information

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GHS Pictogram :
GHS No : GHS07
Signal Word : Warning
UN#: N/A
Class : N/A
Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

  • TPSA   66.93
  • LogP   2.48528
  • H_Acceptors   3
  • H_Donors   0
  • Rotatable_Bonds   1

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